Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 2/20 | 0.45 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.44 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | AXL | P30530 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28909033 | 0.80 | CHEK1 (0.45) | KDM5ANUDT1MAP2K1KDM4EALDH1A1 | |
| SCHEMBL29696528 | 0.80 | KDM5A (0.51) | KDM5AKDM5B | |
| SCHEMBL16150881 | 0.80 | KDM5A (0.51) | KDM5AKDM5B | |
| SCHEMBL29696445 | 0.78 | BTK (0.52) | NUDT1MAP2K1KDM4EMAPK1L3MBTL1 | |
| SCHEMBL19231054 | 0.78 | BTK (0.52) | NUDT1MAP2K1KDM4EMAPK1L3MBTL1 | |
| SCHEMBL29738256 | 0.76 | TSHR (0.49) | KDM5AMAP2K1KDM4EALDH1A1GAA | |
| SCHEMBL26233949 | 0.76 | TSHR (0.49) | KDM5AMAP2K1KDM4EALDH1A1GAA | |
| SCHEMBL7497434 | 0.76 | PIM3 (0.55) | NUDT1MAP2K1KDM4EALDH1A1GAA | |
| SCHEMBL1951650 | 0.75 | NUDT1 (0.73) | NUDT1MAP2K1KDM4EALDH1A1GAA | |
| SCHEMBL29702772 | 0.75 | NUDT1 (0.73) | NUDT1MAP2K1KDM4EALDH1A1GAA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110891935-B | Bicyclic compounds and their use in cancer treatment | 泰普斯特医疗公司 | 2023-12-01 | — | — | CN | disclosed |